3-chloranyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-N-methyl-2-(1-methylsulfanylbenzimidazol-2-yl)pyridin-4-amine

Systemtic Name: 3-chloranyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-N-methyl-2-(1-methylsulfanylbenzimidazol-2-yl)pyridin-4-amine Openeye Name: 3-chloro-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-N-methyl-2-(1-methylsulfanylbenzimidazol-2-yl)pyridin-4-amine CAS Name: 3-chloro-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-N-methyl-2-[1-(methylthio)-2-benzimidazolyl]-4-pyridinamine IUPAC Name: 3-chloro-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-N-methyl-2-(1-methylsulfanylbenzimidazol-2-yl)pyridin-4-amine Traditional Name: [3-chloro-2-[1-(methylthio)benzimidazol-2-yl]-4-pyridyl]-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-methyl-amine Formula: C26H28ClN5S MolecularWeight: 478.05202

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCN1CCC2=CC=CC=C2C1)C3=C(C(=NC=C3)C4=NC5=CC=CC=C5N4SC)Cl

Isomeric SMILES

CN(CCCN1CCC2=CC=CC=C2C1)C3=C(C(=NC=C3)C4=NC5=CC=CC=C5N4SC)Cl

InChI

InChI=1S/C26H28ClN5S/c1-30(15-7-16-31-17-13-19-8-3-4-9-20(19)18-31)23-12-14-28-25(24(23)27)26-29-21-10-5-6-11-22(21)32(26)33-2/h3-6,8-12,14H,7,13,15-18H2,1-2H3